| SpectraBase Spectrum ID |
2CiDeQZrFlg |
| Name |
1,3-Dioxan-4-one, 2-(1,1-dimethylethyl)-5-methyl-5-(phenylmethyl)-, (2S-cis)- |
| CAS Registry Number |
120065-58-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22O3 |
| InChI |
InChI=1S/C16H22O3/c1-15(2,3)14-18-11-16(4,13(17)19-14)10-12-8-6-5-7-9-12/h5-9,14H,10-11H2,1-4H3/t14-,16-/m0/s1 |
| InChIKey |
VQSNQCQSOGEONI-HOCLYGCPSA-N |
| Molecular Weight |
262.349 g/mol |
| SMILES |
[C@@]1(C(O[C@](OC1)(C(C)(C)C)[H])=O)(Cc1ccccc1)C |
| SPLASH |
splash10-053r-1910000000-eb63566e3a13fb201690 |
| Source of Spectrum |
H-71-1152-9 |
| Synonyms |
(2S,5S)-5-Benzyl-2-t-butyl-5-methyl-1,3-dioxan-4-one
(2S,5S)-5-benzyl-2-tert-butyl-5-methyl-1,3-dioxan-4-one |
| Wiley ID |
1266136 |
